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    • A unified platform for fine-tuning atomistic foundation models in chemistry and materials science
      Jupyter Notebook
      MIT License
      97502Updated Apr 10, 2026Apr 10, 2026
    • DOSMatGen

      Public
      Electronic Structure Guided Inverse Design Using Generative Models
      Jupyter Notebook
      GNU General Public License v3.0
      11410Updated Apr 6, 2026Apr 6, 2026
    • Jupyter Notebook
      5100Updated Apr 3, 2026Apr 3, 2026
    • Python
      151925Updated Sep 23, 2025Sep 23, 2025
    • Python
      MIT License
      2102Updated Nov 21, 2024Nov 21, 2024
    • Autonomous Materials Discovery with Large Language Models
      Python
      MIT License
      52110Updated Oct 23, 2024Oct 23, 2024
    • This is the github repository for the Accelerating Materials Discovery with AI VIP team
      1100Updated Aug 21, 2023Aug 21, 2023
    • MatDeepLearn, package for graph neural networks in materials chemistry
      Python
      42204100Updated Mar 20, 2023Mar 20, 2023
    • Atomic Structure Generation from Reconstructing Structural Fingerprints
      Python
      MIT License
      51500Updated Oct 6, 2022Oct 6, 2022
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